methyl N-[[4-phenylsulfanyl-2-(propanoylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[4-phenylsulfanyl-2-(propanoylamino)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[4-phenylsulfanyl-2-(propanoylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-(1-oxopropylamino)-4-(phenylthio)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[4-phenylsulfanyl-2-(propanoylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[4-(phenylthio)-2-propionamido-phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C18H19N3O3S2 MolecularWeight: 389.49176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)SC2=CC=CC=C2)NC(=S)NC(=O)OC

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)SC2=CC=CC=C2)NC(=S)NC(=O)OC

InChI

InChI=1S/C18H19N3O3S2/c1-3-16(22)19-15-11-13(26-12-7-5-4-6-8-12)9-10-14(15)20-17(25)21-18(23)24-2/h4-11H,3H2,1-2H3,(H,19,22)(H2,20,21,23,25)